SCHEMBL9923183

SCHEMBL9923183

CNC(=N)c1ccc2c(=O)n(-c3ccc(NC(=O)NS(=O)(=O)c4ccc(C)s4)cc3F)cnc2c1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 1/20 0.38
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
BTK Q06187 2/20 0.33
KIT P10721 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
MAPK14 Q16539 6/20 0.32
MET P08581 1/20 0.32
CA12 O43570 1/20 0.32
CA9 Q16790 1/20 0.32
BRD4 O60885 1/20 0.32
CREBBP Q92793 1/20 0.32
BLM P54132 2/20 0.31
WEE1 P30291 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL12161336 0.93 P2RY12 (0.46) P2RY12MEN1KMT2ABTKNPC1
SCHEMBL14228581 0.89 P2RY12 (0.42) P2RY12MEN1KMT2ABTKKIT
SCHEMBL13638370 0.88 P2RY12 (0.38) P2RY12BTKNPC1RAB9AMAPK14
SCHEMBL9923204 0.86 P2RY12 (0.41) P2RY12MEN1KMT2AKITNPC1
SCHEMBL12177099 0.86 P2RY12 (0.34) P2RY12MEN1KMT2ABTKCA12
SCHEMBL9923187 0.85 P2RY12 (0.37) P2RY12MEN1KMT2ABTKKIT
SCHEMBL9922732 0.85 P2RY12 (0.42) P2RY12MEN1KMT2ABTK
SCHEMBL12177093 0.85 P2RY12 (0.37) P2RY12MEN1KMT2ABTKKIT
SCHEMBL12177089 0.84 MEN1 (0.41) P2RY12MEN1KMT2AKITMAPK14
SCHEMBL13638714 0.84 P2RY12 (0.46) P2RY12MEN1KMT2ABTKKIT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120149688-A1 PLATELET ADP RECEPTOR INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-06-14 US disclosed
US-7622474-B2 Asulfonyl(urea, thiourea, guanidine, cyanoguanidine) compounds; cardiovascular disorders; thrombosis PORTOLA PHARMACEUTICALS, INC. (US) 2009-11-24 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120149688-A1 PLATELET ADP RECEPTOR INHIBITORS TBXA2R, GP6, P2RY6 P2RY12 18/4885MEN1 4499/4885KMT2A 3023/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.